N-butyl-N-[2-[2-methoxyethyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide

Systemtic Name: N-butyl-N-[2-[2-methoxyethyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide Openeye Name: N-butyl-N-[2-[2-methoxyethyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-butyl-N-[2-[2-methoxyethyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-4-nitrobenzamide IUPAC Name: N-butyl-N-[2-[2-methoxyethyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-4-nitrobenzamide Traditional Name: N-butyl-N-[2-keto-2-[2-methoxyethyl-[(1-methylpyrrol-2-yl)methyl]amino]ethyl]-4-nitro-benzamide Formula: C22H30N4O5 MolecularWeight: 430.4974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CCOC)CC1=CC=CN1C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)N(CCOC)CC1=CC=CN1C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H30N4O5/c1-4-5-13-25(22(28)18-8-10-19(11-9-18)26(29)30)17-21(27)24(14-15-31-3)16-20-7-6-12-23(20)2/h6-12H,4-5,13-17H2,1-3H3